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canSAR1529443
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NAMES
    SMILES
    CC(=O)c1c(C)[nH]c(C(=O)Nc2ccc(N3CCCCCC3)cc2)c1C
    InChI
    InChI=1S/C21H27N3O2/c1-14-19(16(3)25)15(2)22-20(14)21(26)23-17-8-10-18(11-9-17)24-12-6-4-5-7-13-24/h8-11,22H,4-7,12-13H2,1-3H3,(H,23,26)
    MOLECULAR FORMULA
    C21H27N3O2
    CROSS REFERENCES
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    canSAR1529443

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 353.21
    AlogP 4.47
    HBond donors 2
    HBond acceptors 5
    Atoms 53
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1529443.